SCHEMBL29032869

SCHEMBL29032869

BrC(Br)CCc1cccc2c1Cc1ccccc1-2

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.58
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
DRD3 P35462 1/20 0.43
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
HSD17B10 Q99714 1/20 0.35
HTR7 P34969 1/20 0.35
HTR2B P41595 1/20 0.35
MMP12 P39900 1/20 0.33
MMP13 P45452 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28919546 0.88 PNMT (0.53) PNMTDRD2DRD4DRD3NPC1
SCHEMBL5366733 0.84 PNMT (0.72) PNMTDRD2DRD4DRD3NPC1
SCHEMBL7111119 0.84 PNMT (0.63) PNMTDRD2DRD4DRD3NPC1
SCHEMBL27726274 0.84 PNMT (0.58) PNMTDRD2DRD4DRD3NPC1
SCHEMBL7603814 0.83 PNMT (0.70) PNMTDRD2DRD4DRD3NPC1
SCHEMBL9859906 0.83 PNMT (0.70) PNMTDRD2DRD4DRD3NPC1
SCHEMBL7609046 0.83 PNMT (0.70) PNMTDRD2DRD4DRD3NPC1
SCHEMBL6558685 0.83 PNMT (0.70) PNMTDRD2DRD4DRD3NPC1
SCHEMBL5355390 0.81 PNMT (0.64) PNMTDRD2DRD4DRD3NPC1
SCHEMBL6674911 0.81 PNMT (0.68) PNMTDRD2DRD4DRD3NPC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116375914-A Synthesis of cardanol polymer luminescent material with branched fluorene 常州工程职业技术学院 2023-07-04 CN claimed
CN-116375914-A Synthesis of cardanol polymer luminescent material with branched fluorene 常州工程职业技术学院 2023-07-04 CN disclosed
CN-116375914-A Synthesis of cardanol polymer luminescent material with branched fluorene 常州工程职业技术学院 2023-07-04 CN disclosed